6-ethoxycarbonyl-7-methyl-5-phenyl-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid

Systemtic Name: 6-ethoxycarbonyl-7-methyl-5-phenyl-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Openeye Name: 6-ethoxycarbonyl-7-methyl-5-phenyl-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid CAS Name: 6-ethoxycarbonyl-7-methyl-5-phenyl-2-pyrazolo[1,5-a]pyrimidinecarboxylic acid IUPAC Name: 6-ethoxycarbonyl-7-methyl-5-phenylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid Traditional Name: 6-carbethoxy-7-methyl-5-phenyl-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Formula: C17H15N3O4 MolecularWeight: 325.3187

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N2C(=CC(=N2)C(=O)O)N=C1C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N2C(=CC(=N2)C(=O)O)N=C1C3=CC=CC=C3)C

InChI

InChI=1S/C17H15N3O4/c1-3-24-17(23)14-10(2)20-13(9-12(19-20)16(21)22)18-15(14)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3,(H,21,22)